Vitas-M small molecule compound
5-[3-(4-chloro-2-methylphenoxy)propyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK466217
SMILES CCn1c(CCCOc2ccc(cc2C)Cl)nnc1S
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C14H18ClN3OS MW 311.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18ClN3OS/c1-3-18-13(16-17-14(18)20)5-4-8-19-12-7-6-11(15)9-10(12)2/h6-7,9H,3-5,8H2,1-2H3,(H,17,20)InChIKey
YTXXOMBBXTUUMS-UHFFFAOYSA-NSynonyms
847503-29-13(3(4chloro2methylphenoxy)propyl)4ethyl1H124triazole5thione
5(3(4CHLORO2METHYLPHENOXY)PROPYL)4ETHYL124TRIAZOLE3THIOL
5(3(4chloro2methylphenoxy)propyl)4ethyl4H124triazole3thiol
847503291
CCN1C(=NNC1=S)CCCOC2=C(C=C(C=C2)Cl)C
InChI=1SC14H18ClN3OSc131813(161714(18)20)54819127611(15)910(12)2h679H358H212H3(H1720)
MFCD04968879
ZINC000002536722
ZINC02536722
ZINC2536722
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